input word = C00054381

Metabolite InformationStructural formula
Name Armillarilin
Formula C24H30O7
Mw 430.19915331
CAS RN 127500-59-8
C_ID C00054381
InChIKey JGQMXVRWAOSIBE-NUXVFQDLSA-N
InChICode InChI=1S/C24H30O7/c1-13-6-15(30-5)7-16(26)19(13)20(27)31-18-10-22(4)17-9-21(2,3)12-23(17,28)8-14(11-25)24(18,22)29/h6-8,11,17-18,26,28-29H,9-10,12H2,1-5H3/t17-,18-,22-,23+,24+/m1/s1
SMILES COC1=CC(C)=C(C(O[C@H]2[C@](C(C=O)=C[C@@]3(O)[C@]4([H])CC(C)(C)C3)(O)[C@]4(C)C2)=O)C(O)=C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPhysalacriaceaeArmillaria mellea Ref.
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